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Details

Stereochemistry MIXED
Molecular Formula C30H32N2O14S5
Molecular Weight 804.905
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SOLASULFONE FREE ACID

SMILES

OS(=O)(=O)C(CC(C1=CC=CC=C1)S(O)(=O)=O)NC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(NC(CC(C4=CC=CC=C4)S(O)(=O)=O)S(O)(=O)=O)C=C3

InChI

InChIKey=HCCUQCPVNVAHMV-UHFFFAOYSA-N
InChI=1S/C30H32N2O14S5/c33-47(34,25-15-11-23(12-16-25)31-29(50(41,42)43)19-27(48(35,36)37)21-7-3-1-4-8-21)26-17-13-24(14-18-26)32-30(51(44,45)46)20-28(49(38,39)40)22-9-5-2-6-10-22/h1-18,27-32H,19-20H2,(H,35,36,37)(H,38,39,40)(H,41,42,43)(H,44,45,46)

HIDE SMILES / InChI

Molecular Formula C30H32N2O14S5
Molecular Weight 804.905
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:26:44 UTC 2023
Edited
by admin
on Sat Dec 16 14:26:44 UTC 2023
Record UNII
8AZ283GK93
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SOLASULFONE FREE ACID
Common Name English
1,1'-(SULFONYLBIS(P-PHENYLIMINO)BIS-(3-PHENYL-1,3-PROPANEDISULFONIC ACID)
Systematic Name English
PHENOPRYLDIASULFONE
Common Name English
Code System Code Type Description
FDA UNII
8AZ283GK93
Created by admin on Sat Dec 16 14:26:44 UTC 2023 , Edited by admin on Sat Dec 16 14:26:44 UTC 2023
PRIMARY
PUBCHEM
8627
Created by admin on Sat Dec 16 14:26:44 UTC 2023 , Edited by admin on Sat Dec 16 14:26:44 UTC 2023
PRIMARY
EPA CompTox
DTXSID50861789
Created by admin on Sat Dec 16 14:26:44 UTC 2023 , Edited by admin on Sat Dec 16 14:26:44 UTC 2023
PRIMARY
CAS
118-84-3
Created by admin on Sat Dec 16 14:26:44 UTC 2023 , Edited by admin on Sat Dec 16 14:26:44 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT